5-[4-(4-but-3-enylphenyl)cyclohexyl]-2-(2-phenylethynyl)benzenecarbonitrile

Systemtic Name: 5-[4-(4-but-3-enylphenyl)cyclohexyl]-2-(2-phenylethynyl)benzenecarbonitrile Openeye Name: 5-[4-(4-but-3-enylphenyl)cyclohexyl]-2-(2-phenylethynyl)benzonitrile CAS Name: 5-[4-(4-but-3-enylphenyl)cyclohexyl]-2-(2-phenylethynyl)benzonitrile IUPAC Name: 5-[4-(4-but-3-enylphenyl)cyclohexyl]-2-(2-phenylethynyl)benzonitrile Traditional Name: 5-[4-(4-but-3-enylphenyl)cyclohexyl]-2-(2-phenylethynyl)benzonitrile Formula: C31H29N MolecularWeight: 415.56866

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1=CC=C(C=C1)C2CCC(CC2)C3=CC(=C(C=C3)C#CC4=CC=CC=C4)C#N

Isomeric SMILES

C=CCCC1=CC=C(C=C1)C2CCC(CC2)C3=CC(=C(C=C3)C#CC4=CC=CC=C4)C#N

InChI

InChI=1S/C31H29N/c1-2-3-7-25-11-13-26(14-12-25)27-16-18-28(19-17-27)30-21-20-29(31(22-30)23-32)15-10-24-8-5-4-6-9-24/h2,4-6,8-9,11-14,20-22,27-28H,1,3,7,16-19H2